[3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine

C12H15N3S — CID 117143199

IUPAC[3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
SMILESNCc1ccn2c(C3CCSC3)ncc2c1
InChIInChI=1S/C12H15N3S/c13-6-9-1-3-15-11(5-9)7-14-12(15)10-2-4-16-8-10/h1,3,5,7,10H,2,4,6,8,13H2
InChIKeyUHUPPVPKWYYGJW-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.01
Rot. Bonds2

About [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine

[3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine (PubChem CID 117143199) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine.

Molecular Properties

Compound Name[3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
PubChem CID117143199
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC Name[3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
SMILESNCc1ccn2c(C3CCSC3)ncc2c1
InChIInChI=1S/C12H15N3S/c13-6-9-1-3-15-11(5-9)7-14-12(15)10-2-4-16-8-10/h1,3,5,7,10H,2,4,6,8,13H2
InChIKeyUHUPPVPKWYYGJW-UHFFFAOYSA-N
XLogP2.01
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-cyclohexylimidazo[1,5-a]pyridin-7-yl)methanamine
CID 83840212
[3-(oxan-4-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143209
[3-(thiolan-2-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143269
[3-(oxan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143251
[3-(1-ethylpyrrolidin-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143205
7-methyl-3-(thian-3-yl)imidazo[1,5-a]pyridine
CID 117143992
[3-(1-methylpyrrolidin-2-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143272
[3-(1,1-dioxothiolan-2-yl)imidazo[1,5-a]pyridin-7-yl]methanamine
CID 117143267
[1-cyclopropyl-2-(thiolan-3-yl)benzimidazol-5-yl]methanamine
CID 65037708
[3-methyl-2-(thiolan-3-yl)benzimidazol-5-yl]methanamine
CID 104712857
3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-7-amine
CID 117143877
3-cyclohexylimidazo[1,5-a]pyridin-7-amine
CID 83835629

Frequently Asked Questions

What is the IUPAC name of [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine?
The IUPAC name of [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine (CID 117143199) is [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine.
What is the SMILES notation for [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine?
The canonical SMILES for [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine is NCc1ccn2c(C3CCSC3)ncc2c1.
What is the InChIKey of [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine?
The InChIKey is UHUPPVPKWYYGJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c13-6-9-1-3-15-11(5-9)7-14-12(15)10-2-4-16-8-10/h1,3,5,7,10H,2,4,6,8,13H2.
What are the key properties of [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine?
[3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine has a molecular weight of 233.34 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-yl]methanamine is sourced from PubChem (CID 117143199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).